diethyl-[(4S)-4-[3-[[(1R)-1-phenylethyl]azaniumyl]propanoylamino]pentyl]azanium

Systemtic Name: diethyl-[(4S)-4-[3-[[(1R)-1-phenylethyl]azaniumyl]propanoylamino]pentyl]azanium Openeye Name: diethyl-[(4S)-4-[3-[[(1R)-1-phenylethyl]ammonio]propanoylamino]pentyl]ammonium CAS Name: diethyl-[(4S)-4-[[1-oxo-3-[[(1R)-1-phenylethyl]ammonio]propyl]amino]pentyl]ammonium IUPAC Name: diethyl-[(4S)-4-[3-[[(1R)-1-phenylethyl]azaniumyl]propanoylamino]pentyl]azanium Traditional Name: diethyl-[(4S)-4-[3-[[(1R)-1-phenylethyl]ammonio]propanoylamino]pentyl]ammonium Formula: C20H37N3O+2 MolecularWeight: 335.52728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)NC(=O)CC[NH2+]C(C)C1=CC=CC=C1

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)NC(=O)CC[NH2+][C@H](C)C1=CC=CC=C1

InChI

InChI=1S/C20H35N3O/c1-5-23(6-2)16-10-11-17(3)22-20(24)14-15-21-18(4)19-12-8-7-9-13-19/h7-9,12-13,17-18,21H,5-6,10-11,14-16H2,1-4H3,(H,22,24)/p+2/t17-,18+/m0/s1